# generated using pymatgen
data_Y7BeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66208260
_cell_length_b   9.66208161
_cell_length_c   9.66208197
_cell_angle_alpha   107.60131417
_cell_angle_beta   107.60131552
_cell_angle_gamma   107.60130688
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y7BeI12
_chemical_formula_sum   'Y7 Be1 I12'
_cell_volume   738.53546911
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Y  Y0  1  0.70024531  0.97164297  0.90144892  1.0
  Y  Y1  1  0.97164297  0.90144892  0.70024531  1.0
  Y  Y2  1  0.50000000  0.50000000  0.50000000  1.0
  Y  Y3  1  0.09855108  0.29975469  0.02835703  1.0
  Y  Y4  1  0.29975469  0.02835703  0.09855108  1.0
  Y  Y5  1  0.90144892  0.70024531  0.97164297  1.0
  Y  Y6  1  0.02835703  0.09855108  0.29975469  1.0
  Be  Be7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.07598702  0.22876526  0.68150015  1.0
  I  I9  1  0.38943563  0.15614317  0.46917926  1.0
  I  I10  1  0.61056437  0.84385683  0.53082074  1.0
  I  I11  1  0.22876526  0.68150015  0.07598702  1.0
  I  I12  1  0.77123474  0.31849985  0.92401298  1.0
  I  I13  1  0.68150015  0.07598702  0.22876526  1.0
  I  I14  1  0.53082074  0.61056437  0.84385683  1.0
  I  I15  1  0.84385683  0.53082074  0.61056437  1.0
  I  I16  1  0.92401298  0.77123474  0.31849985  1.0
  I  I17  1  0.31849985  0.92401298  0.77123474  1.0
  I  I18  1  0.46917926  0.38943563  0.15614317  1.0
  I  I19  1  0.15614317  0.46917926  0.38943563  1.0